methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium

C9H14N2 — CID 10329439

IUPACmethanidyl-dimethyl-(pyridin-2-ylmethyl)azanium
SMILES[CH2-][N+](C)(C)Cc1ccccn1
InChIInChI=1S/C9H14N2/c1-11(2,3)8-9-6-4-5-7-10-9/h4-7H,1,8H2,2-3H3
InChIKeyBLRZKPMGLCSDGM-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.45
Rot. Bonds2

About methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium

methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium (PubChem CID 10329439) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium.

Molecular Properties

Compound Namemethanidyl-dimethyl-(pyridin-2-ylmethyl)azanium
PubChem CID10329439
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Namemethanidyl-dimethyl-(pyridin-2-ylmethyl)azanium
SMILES[CH2-][N+](C)(C)Cc1ccccn1
InChIInChI=1S/C9H14N2/c1-11(2,3)8-9-6-4-5-7-10-9/h4-7H,1,8H2,2-3H3
InChIKeyBLRZKPMGLCSDGM-UHFFFAOYSA-N
XLogP1.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

2-ethylpyridine;sulfane
CID 67363352
ethane;pyridin-2-ylmethanamine
CID 90791011
ethane;2-ethylpyridine
CID 91102000
acetylene;2-ethylpyridine
CID 145358493
ethane;pyridin-2-ylmethanol
CID 91461493
ethane;2-ethylpyridine;methane
CID 142439308
2-(chloromethyl)pyridine;hydron;chloride
CID 67269716
2-(pyridin-2-ylmethylsulfanylmethyl)pyridine
CID 12047870
pyridin-2-ylmethanol;vanadium
CID 176962038
2-(fluoromethyl)pyridine;hydroiodide
CID 173061202
2-(14-pyridin-2-yltetradecyl)pyridine
CID 10594187
lithium pyridin-2-ylmethanethiolate
CID 20660763

Frequently Asked Questions

What is the IUPAC name of methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium?
The IUPAC name of methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium (CID 10329439) is methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium.
What is the SMILES notation for methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium?
The canonical SMILES for methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium is [CH2-][N+](C)(C)Cc1ccccn1.
What is the InChIKey of methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium?
The InChIKey is BLRZKPMGLCSDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-11(2,3)8-9-6-4-5-7-10-9/h4-7H,1,8H2,2-3H3.
What are the key properties of methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium?
methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium has a molecular weight of 150.22 g/mol, XLogP of 1.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanidyl-dimethyl-(pyridin-2-ylmethyl)azanium is sourced from PubChem (CID 10329439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).